3-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-2H-1-benzopyran-2-one
3-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M321-0513 |
| Compound Name: | 3-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 384.39 |
| Molecular Formula: | C22 H16 N4 O3 |
| Smiles: | CCn1c(ccn1)c1cccc(c1)c1nc(C2=Cc3ccccc3OC2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.0949 |
| logD: | 4.0949 |
| logSw: | -4.3712 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.383 |
| InChI Key: | NTDHWFNZTQLBRC-UHFFFAOYSA-N |